| Chain sequence(s) |
A: ACSALPSSFTLTSNEKLVDLFTHFNGTKVTTKAEFACRQAELSELIQRYELGTLPGRPSTLTASFSGNTLTINCGENGKSISFTVTITYPSSGTAPYPAIIGFGGGSIPQPDGVALINFNNDEIAKQTSSSSRGQGKFYDLYGSSHSAGAMTAWAWGVSRVIDALELTPAANIDTTKIGVTGCSRNGKGALVAGAFEKRIVLTIPQESGMGGSACWRISDYLKSQGKNIQTASEIVGEYPWFSTTFNSYVNTVEKLPFDHHHLAALIAPRGLLVIDNVIDWLGPESCYGCMTAARRAWQALGVPDNMGYSQIGSHSHCAFPSSQQADLTAFVNKFLLGQSVNTAIFSSDFSANESQWIDWTTPTLS
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:01)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:01)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:05:39)
[INFO] Main: Simulation completed successfully. (00:05:44)
|
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan3D score | mutation |
|---|---|---|---|---|
| residue index | residue name | chain | Aggrescan3D score | |
| 1 | A | A | 0.2705 | |
| 2 | C | A | 0.5094 | |
| 3 | S | A | -0.0234 | |
| 4 | A | A | -0.0529 | |
| 5 | L | A | -0.1749 | |
| 6 | P | A | -0.2586 | |
| 7 | S | A | -0.2699 | |
| 8 | S | A | -0.1614 | |
| 9 | F | A | 0.2042 | |
| 10 | T | A | 0.0626 | |
| 11 | L | A | -0.1641 | |
| 12 | T | A | -0.6334 | |
| 13 | S | A | -1.3554 | |
| 14 | N | A | -1.9146 | |
| 15 | E | A | -2.5887 | |
| 16 | K | A | -2.1726 | |
| 17 | L | A | 0.0000 | |
| 18 | V | A | -0.6967 | |
| 19 | D | A | -0.6239 | |
| 20 | L | A | 0.0000 | |
| 21 | F | A | 0.0000 | |
| 22 | T | A | -1.0728 | |
| 23 | H | A | -1.0329 | |
| 24 | F | A | -0.4867 | |
| 25 | N | A | -1.4896 | |
| 26 | G | A | -1.3511 | |
| 27 | T | A | -1.4683 | |
| 28 | K | A | -2.1019 | |
| 29 | V | A | 0.0000 | |
| 30 | T | A | -0.9939 | |
| 31 | T | A | -1.1109 | |
| 32 | K | A | -1.4349 | |
| 33 | A | A | -0.7449 | |
| 34 | E | A | -1.1254 | |
| 35 | F | A | 0.0000 | |
| 36 | A | A | -0.3611 | |
| 37 | C | A | -0.1355 | |
| 38 | R | A | 0.0000 | |
| 39 | Q | A | -0.3847 | |
| 40 | A | A | -0.2942 | |
| 41 | E | A | -0.3325 | |
| 42 | L | A | 0.0000 | |
| 43 | S | A | -0.6694 | |
| 44 | E | A | -1.1680 | |
| 45 | L | A | 0.0000 | |
| 46 | I | A | 0.0000 | |
| 47 | Q | A | -0.6973 | |
| 48 | R | A | -0.8007 | |
| 49 | Y | A | -0.4470 | |
| 50 | E | A | 0.0000 | |
| 51 | L | A | 0.0000 | |
| 52 | G | A | 0.0000 | |
| 53 | T | A | -0.3432 | |
| 54 | L | A | -0.2225 | |
| 55 | P | A | -0.5280 | |
| 56 | G | A | -1.3370 | |
| 57 | R | A | -2.1167 | |
| 58 | P | A | 0.0000 | |
| 59 | S | A | -1.0670 | |
| 60 | T | A | -0.9186 | |
| 61 | L | A | -0.2338 | |
| 62 | T | A | 0.1209 | |
| 63 | A | A | 0.0186 | |
| 64 | S | A | 0.0512 | |
| 65 | F | A | -0.0193 | |
| 66 | S | A | -0.5726 | |
| 67 | G | A | -0.9288 | |
| 68 | N | A | -1.0767 | |
| 69 | T | A | -0.7098 | |
| 70 | L | A | 0.0000 | |
| 71 | T | A | -0.1930 | |
| 72 | I | A | 0.0000 | |
| 73 | N | A | -0.5159 | |
| 74 | C | A | 0.0000 | |
| 75 | G | A | -1.5080 | |
| 76 | E | A | -1.8990 | |
| 77 | N | A | -2.1966 | |
| 78 | G | A | -2.0530 | |
| 79 | K | A | -2.8006 | |
| 80 | S | A | -1.8426 | |
| 81 | I | A | 0.0000 | |
| 82 | S | A | -0.4496 | |
| 83 | F | A | 0.0000 | |
| 84 | T | A | -0.4557 | |
| 85 | V | A | 0.0000 | |
| 86 | T | A | -0.6954 | |
| 87 | I | A | 0.0000 | |
| 88 | T | A | -0.2259 | |
| 89 | Y | A | -0.1796 | |
| 90 | P | A | -0.5924 | |
| 91 | S | A | -0.6459 | |
| 92 | S | A | -0.8639 | |
| 93 | G | A | -0.8228 | |
| 94 | T | A | -0.4580 | |
| 95 | A | A | -0.4814 | |
| 96 | P | A | -0.7986 | |
| 97 | Y | A | -0.3464 | |
| 98 | P | A | -0.3275 | |
| 99 | A | A | 0.0000 | |
| 100 | I | A | 0.0000 | |
| 101 | I | A | 0.0000 | |
| 102 | G | A | 0.0000 | |
| 103 | F | A | 0.0000 | |
| 104 | G | A | -1.1714 | |
| 105 | G | A | -0.8596 | |
| 106 | G | A | -0.4960 | |
| 107 | S | A | -0.1776 | |
| 108 | I | A | -0.0234 | |
| 109 | P | A | -0.5596 | |
| 110 | Q | A | -0.9350 | |
| 111 | P | A | -1.2482 | |
| 112 | D | A | -2.0364 | |
| 113 | G | A | 0.0000 | |
| 114 | V | A | 0.0000 | |
| 115 | A | A | 0.0000 | |
| 116 | L | A | -0.0762 | |
| 117 | I | A | 0.0000 | |
| 118 | N | A | -1.1756 | |
| 119 | F | A | 0.0000 | |
| 120 | N | A | -1.6084 | |
| 121 | N | A | 0.0000 | |
| 122 | D | A | -1.6252 | |
| 123 | E | A | -1.6020 | |
| 124 | I | A | 0.0000 | |
| 125 | A | A | 0.0000 | |
| 126 | K | A | -1.5411 | |
| 127 | Q | A | 0.0000 | |
| 128 | T | A | -0.4999 | |
| 129 | S | A | -0.5831 | |
| 130 | S | A | -0.7059 | |
| 131 | S | A | -0.7975 | |
| 132 | S | A | 0.0000 | |
| 133 | R | A | -1.1497 | |
| 134 | G | A | 0.0000 | |
| 135 | Q | A | -2.0080 | |
| 136 | G | A | -1.8148 | |
| 137 | K | A | -1.6862 | |
| 138 | F | A | 0.0000 | |
| 139 | Y | A | 0.0000 | |
| 140 | D | A | -2.5069 | |
| 141 | L | A | 0.0000 | |
| 142 | Y | A | -1.0851 | |
| 143 | G | A | -1.2304 | |
| 144 | S | A | -1.2215 | |
| 145 | S | A | -0.6625 | |
| 146 | H | A | -0.4889 | |
| 147 | S | A | -0.3850 | |
| 148 | A | A | 0.0000 | |
| 149 | G | A | 0.0000 | |
| 150 | A | A | 0.0000 | |
| 151 | M | A | 0.0000 | |
| 152 | T | A | 0.0000 | |
| 153 | A | A | 0.0000 | |
| 154 | W | A | 0.0000 | |
| 155 | A | A | 0.0000 | |
| 156 | W | A | 0.0000 | |
| 157 | G | A | 0.0000 | |
| 158 | V | A | 0.0000 | |
| 159 | S | A | -0.7017 | |
| 160 | R | A | 0.0000 | |
| 161 | V | A | 0.0000 | |
| 162 | I | A | 0.0000 | |
| 163 | D | A | 0.0000 | |
| 164 | A | A | 0.0000 | |
| 165 | L | A | 0.0000 | |
| 166 | E | A | -1.1930 | |
| 167 | L | A | 0.6363 | |
| 168 | T | A | 0.0000 | |
| 169 | P | A | -0.5944 | |
| 170 | A | A | -0.3281 | |
| 171 | A | A | 0.0000 | |
| 172 | N | A | -0.9456 | |
| 173 | I | A | 0.0000 | |
| 174 | D | A | -1.0770 | |
| 175 | T | A | -1.0637 | |
| 176 | T | A | -0.6878 | |
| 177 | K | A | -0.5992 | |
| 178 | I | A | 0.0000 | |
| 179 | G | A | 0.0000 | |
| 180 | V | A | 0.0000 | |
| 181 | T | A | 0.0000 | |
| 182 | G | A | 0.0000 | |
| 183 | C | A | 0.0000 | |
| 184 | S | A | -0.4818 | |
| 185 | R | A | -0.6880 | |
| 186 | N | A | -0.6900 | |
| 187 | G | A | 0.0000 | |
| 188 | K | A | 0.0000 | |
| 189 | G | A | 0.0000 | |
| 190 | A | A | 0.0000 | |
| 191 | L | A | 0.0000 | |
| 192 | V | A | 0.0000 | |
| 193 | A | A | 0.0000 | |
| 194 | G | A | 0.0000 | |
| 195 | A | A | 0.0000 | |
| 196 | F | A | 0.0000 | |
| 197 | E | A | 0.0000 | |
| 198 | K | A | -1.9782 | |
| 199 | R | A | -1.4802 | |
| 200 | I | A | 0.0000 | |
| 201 | V | A | -0.3815 | |
| 202 | L | A | 0.0000 | |
| 203 | T | A | 0.0000 | |
| 204 | I | A | 0.0000 | |
| 205 | P | A | 0.0000 | |
| 206 | Q | A | 0.0000 | |
| 207 | E | A | 0.0000 | |
| 208 | S | A | 0.0000 | |
| 209 | G | A | 0.0000 | |
| 210 | M | A | 0.0000 | |
| 211 | G | A | 0.0000 | |
| 212 | G | A | 0.0000 | |
| 213 | S | A | 0.0000 | |
| 214 | A | A | 0.0000 | |
| 215 | C | A | 0.0000 | |
| 216 | W | A | 0.0000 | |
| 217 | R | A | 0.0000 | |
| 218 | I | A | 0.0000 | |
| 219 | S | A | 0.0000 | |
| 220 | D | A | -2.2484 | |
| 221 | Y | A | -1.1552 | |
| 222 | L | A | 0.0000 | |
| 223 | K | A | -2.2147 | |
| 224 | S | A | -1.7272 | |
| 225 | Q | A | -2.1373 | |
| 226 | G | A | -2.0076 | |
| 227 | K | A | -2.3511 | |
| 228 | N | A | -2.1510 | |
| 229 | I | A | 0.0000 | |
| 230 | Q | A | 0.0000 | |
| 231 | T | A | 0.0000 | |
| 232 | A | A | 0.0000 | |
| 233 | S | A | -1.1946 | |
| 234 | E | A | -1.0253 | |
| 235 | I | A | 0.0000 | |
| 236 | V | A | -0.5865 | |
| 237 | G | A | -1.0138 | |
| 238 | E | A | -0.8656 | |
| 239 | Y | A | -0.4425 | |
| 240 | P | A | 0.0000 | |
| 241 | W | A | 0.0000 | |
| 242 | F | A | 0.0000 | |
| 243 | S | A | 0.0000 | |
| 244 | T | A | -0.5886 | |
| 245 | T | A | -0.5630 | |
| 246 | F | A | 0.0000 | |
| 247 | N | A | -1.4852 | |
| 248 | S | A | -0.9266 | |
| 249 | Y | A | -0.8034 | |
| 250 | V | A | -1.2228 | |
| 251 | N | A | -1.8488 | |
| 252 | T | A | -1.4391 | |
| 253 | V | A | 0.0000 | |
| 254 | E | A | -2.0557 | |
| 255 | K | A | -1.4507 | |
| 256 | L | A | 0.0000 | |
| 257 | P | A | -0.2052 | |
| 258 | F | A | 0.0000 | |
| 259 | D | A | 0.0000 | |
| 260 | H | A | 0.0000 | |
| 261 | H | A | 0.0000 | |
| 262 | H | A | 0.0000 | |
| 263 | L | A | 0.0000 | |
| 264 | A | A | 0.0000 | |
| 265 | A | A | 0.0000 | |
| 266 | L | A | 0.0000 | |
| 267 | I | A | 0.0000 | |
| 268 | A | A | 0.0000 | |
| 269 | P | A | -0.4828 | |
| 270 | R | A | -0.5205 | |
| 271 | G | A | 0.0000 | |
| 272 | L | A | 0.0000 | |
| 273 | L | A | 0.0000 | |
| 274 | V | A | 0.0000 | |
| 275 | I | A | 0.0000 | |
| 276 | D | A | 0.0000 | |
| 277 | N | A | 0.0000 | |
| 278 | V | A | 0.5563 | |
| 279 | I | A | 0.1417 | |
| 280 | D | A | -1.0918 | |
| 281 | W | A | -0.3251 | |
| 282 | L | A | 0.0000 | |
| 283 | G | A | 0.0000 | |
| 284 | P | A | 0.0000 | |
| 285 | E | A | -0.4824 | |
| 286 | S | A | 0.0000 | |
| 287 | C | A | 0.0000 | |
| 288 | Y | A | -0.1564 | |
| 289 | G | A | 0.0000 | |
| 290 | C | A | 0.0000 | |
| 291 | M | A | 0.0000 | |
| 292 | T | A | -0.2966 | |
| 293 | A | A | 0.0000 | |
| 294 | A | A | 0.0000 | |
| 295 | R | A | -0.7460 | |
| 296 | R | A | -0.8894 | |
| 297 | A | A | 0.0000 | |
| 298 | W | A | 0.0000 | |
| 299 | Q | A | -1.4849 | |
| 300 | A | A | 0.0000 | |
| 301 | L | A | 0.0000 | |
| 302 | G | A | -0.8326 | |
| 303 | V | A | -0.4844 | |
| 304 | P | A | -0.8369 | |
| 305 | D | A | -0.9860 | |
| 306 | N | A | -0.7799 | |
| 307 | M | A | 0.0000 | |
| 308 | G | A | 0.0000 | |
| 309 | Y | A | 0.0000 | |
| 310 | S | A | 0.0000 | |
| 311 | Q | A | 0.0000 | |
| 312 | I | A | 0.4067 | |
| 313 | G | A | 0.1770 | |
| 314 | S | A | -0.0729 | |
| 315 | H | A | -0.1731 | |
| 316 | S | A | -0.3671 | |
| 317 | H | A | -0.4242 | |
| 318 | C | A | -0.1018 | |
| 319 | A | A | -0.0468 | |
| 320 | F | A | 0.0587 | |
| 321 | P | A | -0.1889 | |
| 322 | S | A | -0.5042 | |
| 323 | S | A | -0.3831 | |
| 324 | Q | A | 0.0000 | |
| 325 | Q | A | -0.7478 | |
| 326 | A | A | -0.4225 | |
| 327 | D | A | -0.5388 | |
| 328 | L | A | 0.0000 | |
| 329 | T | A | -0.5612 | |
| 330 | A | A | -0.4840 | |
| 331 | F | A | 0.0000 | |
| 332 | V | A | 0.0000 | |
| 333 | N | A | -0.7503 | |
| 334 | K | A | -0.7353 | |
| 335 | F | A | -0.2000 | |
| 336 | L | A | 0.0000 | |
| 337 | L | A | -0.3246 | |
| 338 | G | A | -0.7388 | |
| 339 | Q | A | -1.1282 | |
| 340 | S | A | -0.7497 | |
| 341 | V | A | -0.5507 | |
| 342 | N | A | -1.3067 | |
| 343 | T | A | 0.0000 | |
| 344 | A | A | -0.3566 | |
| 345 | I | A | 0.0255 | |
| 346 | F | A | 0.2820 | |
| 347 | S | A | -0.1685 | |
| 348 | S | A | -0.6103 | |
| 349 | D | A | -1.5065 | |
| 350 | F | A | -0.6073 | |
| 351 | S | A | -0.6944 | |
| 352 | A | A | -0.7632 | |
| 353 | N | A | -1.0419 | |
| 354 | E | A | -1.6290 | |
| 355 | S | A | -1.4111 | |
| 356 | Q | A | -1.6128 | |
| 357 | W | A | 0.0000 | |
| 358 | I | A | 0.0000 | |
| 359 | D | A | -2.1165 | |
| 360 | W | A | -0.8931 | |
| 361 | T | A | -0.4982 | |
| 362 | T | A | -0.4146 | |
| 363 | P | A | -0.5380 | |
| 364 | T | A | -0.6123 | |
| 365 | L | A | 0.0000 | |
| 366 | S | A | -0.6990 |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine